9-methyl-N-(4-nitrophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
9-methyl-N-(4-nitrophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
9-methyl-N-(4-nitrophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | C243-0229 |
| Compound Name: | 9-methyl-N-(4-nitrophenyl)-4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C18 H12 N4 O4 S |
| Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(Nc3ccc(cc3)[N+]([O-])=O)=O)s1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 3.2742 |
| logD: | 3.1007 |
| logSw: | -3.7339 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.88 |
| InChI Key: | ORNFMKYEGOLADZ-UHFFFAOYSA-N |